N-tert-butyl-4-(2-chloranyl-4-fluoranyl-phenoxy)-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(2-chloranyl-4-fluoranyl-phenoxy)-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(2-chloro-4-fluoro-phenoxy)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(2-chloro-4-fluorophenoxy)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(2-chloro-4-fluorophenoxy)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(2-chloro-4-fluoro-phenoxy)-3-nitro-benzenesulfonamide Formula: C16H16ClFN2O5S MolecularWeight: 402.825043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClFN2O5S/c1-16(2,3)19-26(23,24)11-5-7-15(13(9-11)20(21)22)25-14-6-4-10(18)8-12(14)17/h4-9,19H,1-3H3